1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine

C21H21N3OS — CID 24593929

IUPAC1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
SMILESCOc1ccccc1CN(C)Cc1c(-c2ccccc2)nc2sccn12
InChIInChI=1S/C21H21N3OS/c1-23(14-17-10-6-7-11-19(17)25-2)15-18-20(16-8-4-3-5-9-16)22-21-24(18)12-13-26-21/h3-13H,14-15H2,1-2H3
InChIKeyMVKGEBPBSHOTAC-UHFFFAOYSA-N
MW363.49 g/mol
LogP4.70
Rot. Bonds6

About 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine

1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine (PubChem CID 24593929) has the molecular formula C21H21N3OS and a molecular weight of 363.49 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
PubChem CID24593929
Molecular FormulaC21H21N3OS
Molecular Weight363.49 g/mol
Exact Mass363.14
IUPAC Name1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
SMILESCOc1ccccc1CN(C)Cc1c(-c2ccccc2)nc2sccn12
InChIInChI=1S/C21H21N3OS/c1-23(14-17-10-6-7-11-19(17)25-2)15-18-20(16-8-4-3-5-9-16)22-21-24(18)12-13-26-21/h3-13H,14-15H2,1-2H3
InChIKeyMVKGEBPBSHOTAC-UHFFFAOYSA-N
XLogP4.70
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.49
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine with MolForge

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Related Compounds

N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-1-amine
CID 3916899
trimethyl-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]azanium
CID 4880467
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(2-methoxyphenyl)methanamine
CID 43758018
2-(2-methoxyphenoxy)-N-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
CID 55868062
7-[[(2,3-dimethoxyphenyl)methyl-methylamino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 18078834
N-methyl-N-[[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]butan-1-amine
CID 3913312
ethane;5-methyl-6-phenylimidazo[2,1-b][1,3]thiazole
CID 144628970
1-(3-methoxyphenyl)-N-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine
CID 30136620
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(2-chloro-3-pyridinyl)-N-methylmethanamine
CID 56918257
N-[[6-(2-methoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 43476724
(Z)-2-[amino-[(3,4-dimethoxyphenyl)methyl]amino]-1-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)ethenamine
CID 155264329
[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 43476612

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine (CID 24593929) is 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine is COc1ccccc1CN(C)Cc1c(-c2ccccc2)nc2sccn12.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The InChIKey is MVKGEBPBSHOTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3OS/c1-23(14-17-10-6-7-11-19(17)25-2)15-18-20(16-8-4-3-5-9-16)22-21-24(18)12-13-26-21/h3-13H,14-15H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine has a molecular weight of 363.49 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine is sourced from PubChem (CID 24593929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).